phenylseleninyl benzeneselenonate

C12H10O4Se2 — CID 141046145

IUPACphenylseleninyl benzeneselenonate
SMILESO=[Se](O[Se](=O)(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C12H10O4Se2/c13-17(11-7-3-1-4-8-11)16-18(14,15)12-9-5-2-6-10-12/h1-10H
InChIKeyLGLZYNREBDZRLM-UHFFFAOYSA-N
MW376.13 g/mol
LogP0.54
Rot. Bonds4

About phenylseleninyl benzeneselenonate

phenylseleninyl benzeneselenonate (PubChem CID 141046145) has the molecular formula C12H10O4Se2 and a molecular weight of 376.13 g/mol. Its IUPAC name is phenylseleninyl benzeneselenonate.

Molecular Properties

Compound Namephenylseleninyl benzeneselenonate
PubChem CID141046145
Molecular FormulaC12H10O4Se2
Molecular Weight376.13 g/mol
Exact Mass377.89
IUPAC Namephenylseleninyl benzeneselenonate
SMILESO=[Se](O[Se](=O)(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C12H10O4Se2/c13-17(11-7-3-1-4-8-11)16-18(14,15)12-9-5-2-6-10-12/h1-10H
InChIKeyLGLZYNREBDZRLM-UHFFFAOYSA-N
XLogP0.54
TPSA60.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.13
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

chloroselenonylbenzene
CID 140969306
phenylselanyl benzeneseleninate
CID 131859486
chloroselenonylbenzene;hydrofluoride
CID 174953141
bromoseleninylbenzene
CID 13071060
methyl (R)-benzenesulfinate
CID 11735002
bis(triphenylstannyl) selenite
CID 71356680
[difluoro(phenyl)-lambda4-selanyl]benzene
CID 12529933
dimethyl 2-benzothiophene-1,3-dicarboxylate
CID 24977408
heptacyclo[18.7.0.02,10.03,8.011,19.012,17.022,27]heptacosa-1,3,5,7,10,12,14,16,19,22,24,26-dodecaene-9,18,21-trione
CID 42643402
cobalt;phenoxyphosphinic acid
CID 153325844
potassium phenyl sulfite
CID 162337240
potassium phenoxybenzene
CID 19858586

Frequently Asked Questions

What is the IUPAC name of phenylseleninyl benzeneselenonate?
The IUPAC name of phenylseleninyl benzeneselenonate (CID 141046145) is phenylseleninyl benzeneselenonate.
What is the SMILES notation for phenylseleninyl benzeneselenonate?
The canonical SMILES for phenylseleninyl benzeneselenonate is O=[Se](O[Se](=O)(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of phenylseleninyl benzeneselenonate?
The InChIKey is LGLZYNREBDZRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O4Se2/c13-17(11-7-3-1-4-8-11)16-18(14,15)12-9-5-2-6-10-12/h1-10H.
What are the key properties of phenylseleninyl benzeneselenonate?
phenylseleninyl benzeneselenonate has a molecular weight of 376.13 g/mol, XLogP of 0.54, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenylseleninyl benzeneselenonate is sourced from PubChem (CID 141046145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).